Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 6/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 4/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.37 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL576708 | 0.84 | MAPT (0.46) | CYP2C9CYP2C19CYP3A4ALDH1A1THRB | |
| SCHEMBL577132 | 0.81 | KMT2A (0.41) | ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL7614274 | 0.79 | CYP2C9 (0.38) | CYP2C9CYP2C19CYP3A4ALDH1A1TSHR | |
| SCHEMBL7619728 | 0.75 | CYP3A4 (0.37) | CYP2C9CYP2C19CYP3A4ALDH1A1TSHR | |
| SCHEMBL7611302 | 0.70 | MTNR1A (0.42) | CYP2C9CYP2C19CYP3A4ALDH1A1TSHR | |
| SCHEMBL7965208 | 0.69 | MEN1 (0.41) | ALDH1A1MEN1MAPTKMT2APOLB | |
| SCHEMBL10550344 | 0.68 | CYP3A4 (0.46) | CYP2C9CYP2C19CYP3A4ALDH1A1TSHR | |
| SCHEMBL980741 | 0.68 | CYP19A1 (0.40) | ALDH1A1THRBMEN1MAPTKMT2A | |
| SCHEMBL1239882 | 0.67 | TP53 (0.41) | CYP2C9CYP2C19CYP3A4ALDH1A1TSHR | |
| SCHEMBL3432798 | 0.67 | CYP19A1 (0.39) | CYP2C9CYP2C19CYP3A4ALDH1A1TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5708169-A | BACTERICIDES FOR TREATMENT OF GRAM POSITIVE INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1998-01-13 | — | — | US | disclosed |